element(s):
['Zr']
AFLOW prototype label:
A_cI2_229_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.5751']
model name:
EAM_Dynamo_MendelevSordeletKramer_2007_CuZr__MO_120596890176_005
==== Building ASE atoms object with: ====
representative atom symbols =  ['Zr']
representative atom coordinates =  [[0 0 0]]
spacegroup =  229
cell =  [[3.5751, 0, 0], [0, 3.5751, 0], [0, 0, 3.5751]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:17:32      -12.833497         0.145974
BFGS:    1 16:17:32      -12.834287         0.106166
BFGS:    2 16:17:32      -12.835101         0.011224
BFGS:    3 16:17:32      -12.835109         0.000654
BFGS:    4 16:17:32      -12.835109         0.000004
BFGS:    5 16:17:32      -12.835109         0.000000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 3.135972511820678e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Zr', 'Zr']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[3.5623285650973053, 1.519075042845729e-32, -8.538576380342142e-34], [2.307313783178052e-33, 3.5623285650973053, -2.110183271954216e-19], [4.634738075153725e-33, -2.1101832719542168e-19, 3.5623285650973053]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-3.13597251e-10 -3.13597251e-10 -3.13597251e-10  6.30029787e-27
  4.04707517e-35  9.97768424e-52]
energy per atom =  -6.417554674551711
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0